NCID-ZINC01727262 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3740 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -0.6840 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 0.0430 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 1.4300 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 2.2030 -0.0210 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6130 3.4210 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7150 1.6220 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2500 -2.1590 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -2.7470 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -2.8540 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -4.3190 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -4.8560 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 -6.3210 -0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -7.0160 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 -6.4280 0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 -8.4910 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -9.1710 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -10.5490 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -11.2640 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5710 -10.6050 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 -9.2180 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8330 -11.3780 -0.0100 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.8010 -12.5960 -0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9040 -10.7970 0.0030 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.8990 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -2.3850 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -4.6680 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -4.6780 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -4.5070 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 -4.4980 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 -6.7900 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 -8.6180 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -11.0740 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 -12.3440 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6110 -0.6060 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8000 -8.5690 0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1580 -8.3760 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 -0.7900 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 39 42 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 24 1 M CHG 1 26 -1 M END